CID 171119286
Anteiso-heptadeca-9,13-dienoic acid
Structural Information
- Molecular Formula
- C17H30O2
- SMILES
- CC/C(=C\CC/C=C\CCCCCCCC(=O)O)/C
- InChI
- InChI=1S/C17H30O2/c1-3-16(2)14-12-10-8-6-4-5-7-9-11-13-15-17(18)19/h6,8,14H,3-5,7,9-13,15H2,1-2H3,(H,18,19)/b8-6-,16-14-
- InChIKey
- GDRUZUOQVOOIRW-CIINBXFRSA-N
- Compound name
- (9Z,13Z)-14-methylhexadeca-9,13-dienoic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 267.23186 | 172.5 |
[M+Na]+ | 289.21380 | 175.3 |
[M-H]- | 265.21730 | 169.6 |
[M+NH4]+ | 284.25840 | 188.4 |
[M+K]+ | 305.18774 | 171.3 |
[M+H-H2O]+ | 249.22184 | 166.5 |
[M+HCOO]- | 311.22278 | 190.3 |
[M+CH3COO]- | 325.23843 | 199.3 |
[M+Na-2H]- | 287.19925 | 170.7 |
[M]+ | 266.22403 | 175.4 |
[M]- | 266.22513 | 175.4 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.